Methylsulfonylpentachlorobenzene
TL;DR: Methylsulfonylpentachlorobenzene (CAS 67646-65-5) is a chemical compound with molecular formula C7H3Cl5O2S and molecular weight 325.83 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4,5-pentachloro-6-methylsulfonylbenzene
Also Known As: Pcpso2Me, Methylsulfonylpentachlorobenzene, Pentachlorophenyl methyl sulfone, Methylpentachlorophenyl sulfone, methylsulphonylpentachlorobenzene
| Molecular Formula | C7H3Cl5O2S |
|---|---|
| Molecular Weight | 325.83 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 327.8267 |
| Heavy Atoms | 15 |
| Complexity | 311.0 |
Chemical Identifiers
| CAS Number | 67646-65-5 |
|---|---|
| SMILES | CS(=O)(=O)C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl |
| InChIKey | VMFKDZZSEHJOSP-UHFFFAOYSA-N |
Product Overview
Methylsulfonylpentachlorobenzene (CAS 67646-65-5), with molecular formula C7H3Cl5O2S and molecular weight 325.83 g/mol. IUPAC: 1,2,3,4,5-pentachloro-6-methylsulfonylbenzene.
Chemical Property Profile of Methylsulfonylpentachlorobenzene
Property Insights of Methylsulfonylpentachlorobenzene
The XLogP value of 4.3 indicates that Methylsulfonylpentachlorobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.5 Ų, Methylsulfonylpentachlorobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methylsulfonylpentachlorobenzene has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methylsulfonylpentachlorobenzene?
The CAS number of Methylsulfonylpentachlorobenzene is 67646-65-5.
What is the molecular formula of Methylsulfonylpentachlorobenzene?
The molecular formula of Methylsulfonylpentachlorobenzene is C7H3Cl5O2S.
What is the molecular weight of Methylsulfonylpentachlorobenzene?
The molecular weight of Methylsulfonylpentachlorobenzene is 325.83 g/mol.
Where can I buy Methylsulfonylpentachlorobenzene?
You can request a quote for Methylsulfonylpentachlorobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methylsulfonylpentachlorobenzene?
Yes, KEHONG BIO provides custom synthesis services for Methylsulfonylpentachlorobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.